Geometry & MOs

Info

ID:

161736

PubChem CID:

57392482

Reduced:

FN2O2H17C24 (1)

Stoich.:

AB2C2D17E24 (1)

Weight, g/mol:

669.139546

ΔHf, kcal/mol:

7.75

Dipole, Da:

5.57

IP(EA), eV:

 -8.98(-0.99)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4S,5R)-5-[3,5-bis(trifluoromethyl)phenyl]-3-[[2-(4-fluoro-2-methoxy-5-propan-2-ylphenyl)-5-(trifluoromethylsulfanyl)phenyl]methyl]-4-methyl-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)F)/C=C/C(=O)C4=CC=C(C=C4)O

DOS

IR

Vibrations